(4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione

Systemtic Name: (4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Openeye Name: (4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione CAS Name: (4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione IUPAC Name: (4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Traditional Name: (4S,4aS)-1-phenethyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Formula: C22H23NS2 MolecularWeight: 365.55472

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C2C(C1)C(SC(=S)N2CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC=C2[C@H](C1)[C@H](SC(=S)N2CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23NS2/c24-22-23(16-15-17-9-3-1-4-10-17)20-14-8-7-13-19(20)21(25-22)18-11-5-2-6-12-18/h1-6,9-12,14,19,21H,7-8,13,15-16H2/t19-,21+/m0/s1